Geometry & MOs

Info

ID:	131992
PubChem CID:	51287854
Reduced:	OSCl2N3H11C12 (1)
Stoich.:	ABC2D3E11F12 (1)
Weight, g/mol:	359.110376
ΔH_f, kcal/mol:	17.09
Dipole, Da:	1.3
IP(EA), eV:	-8.59(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-fluorophenyl)-2-methylpropyl]-2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1(CC1(Cl)Cl)C(=O)NC2=NC(=CS2)C3=CC=CN3

DOS

IR

Vibrations